Octadecanoic Acid 4-Hydroxy-3-Methoxy-Benzylamide
Representations & DB's id
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| ChEBI: | None | |
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| ChEMBL: | CHEMBL78533 | |
| PubChem: | 3024455 | |
| IUPAC: | N-[(4-hydroxy-3-methoxyphenyl)methyl]octadecanamide | |
| Standard InChI: | InChI=1S/C26H45NO3/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-26(29)27-22-23-19-20-24(28)25(21-23)30-2/h19-21,28H,3-18,22H2,1-2H3,(H,27,29) | |
| Standard InChI Key: | SBFFPOWNFONUBK-UHFFFAOYSA-N | |
| SMILES: | CCCCCCCCCCCCCCCCCC(=NCc1ccc(c(c1)OC)O)O | |
Molecular propeties
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| AlogP: | 7.28 | |
|---|---|---|
| Hydrogen bonds acceptors: | 3 | |
| Hydrogen bonds donors: | 2 | |
| Rotatable bonds: | 19 | |
| Number of rings: | 1 | |
| Molecular Weight: | 419.34 | |
| Topological polar surface area: | 58.6 | |
| Number of aromatic rings: | 1 | |
| Fsp3: | 0.731 | |
| Number of carbons: | 26 | |
In vitro data
| Activity Type | Activity Value | Target Name | UniProt ID | Ref. |
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